phenacyl 4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxylate

Systemtic Name: phenacyl 4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxylate Openeye Name: phenacyl 4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxylic acid phenacyl ester IUPAC Name: phenacyl 4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxylic acid phenacyl ester Formula: C19H15FO4S MolecularWeight: 358.383403

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(SC2=CC=CC(=C21)F)C(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

COCC1=C(SC2=CC=CC(=C21)F)C(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H15FO4S/c1-23-10-13-17-14(20)8-5-9-16(17)25-18(13)19(22)24-11-15(21)12-6-3-2-4-7-12/h2-9H,10-11H2,1H3